#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orm s THR 2 N 0.00 0.00 -0.27 0.00 -1.32 -1.26 -5.00 115.64 107.79 1orm s THR 2 Ca 0.00 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.16 1orm s THR 2 Cb 0.00 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.16 1orm s THR 2 CO 0.00 0.00 1.33 -0.55 -2.21 0.00 0.00 174.62 173.19 1orm s SER 3 N 0.61 -0.06 -0.40 8.08 0.15 -1.26 -4.76 113.70 116.07 1orm s SER 3 Ca -0.01 0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.74 1orm s SER 3 Cb -0.04 0.05 0.31 0.00 -1.71 0.00 0.00 66.02 64.62 1orm s SER 3 CO -0.10 -0.07 1.23 0.41 1.20 0.00 0.00 173.24 175.91 1orm n THR 4 N 0.32 0.00 -2.79 6.45 -1.04 0.39 -4.73 114.28 112.88 1orm n THR 4 Ca 0.01 -1.22 -0.36 0.00 -2.04 0.00 0.00 64.05 60.44 1orm n THR 4 Cb 0.58 1.17 -0.07 0.00 -1.82 0.00 0.00 70.33 70.19 1orm n THR 4 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1orm s VAL 5 N 0.17 4.24 -0.09 12.58 1.01 -1.24 -2.02 120.40 135.05 1orm s VAL 5 Ca 0.19 1.78 0.01 0.00 0.00 0.00 0.00 61.98 63.96 1orm s VAL 5 Cb 0.29 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1orm s VAL 5 CO -0.09 0.08 0.68 1.07 0.00 0.00 0.00 175.10 176.84 1orm n THR 6 N 0.40 0.00 -3.73 3.92 5.66 -1.23 -3.89 114.28 115.41 1orm n THR 6 Ca 0.03 -0.19 -0.14 0.00 -3.05 0.00 0.00 64.05 60.70 1orm n THR 6 Cb 0.51 0.54 -0.15 0.00 -1.55 0.00 0.00 70.33 69.67 1orm n THR 6 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1orm s GLY 7 N -0.08 -0.01 0.00 1.09 0.00 -0.56 -4.75 107.32 103.02 1orm s GLY 7 Ca 0.01 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1orm s GLY 7 CO -0.01 1.12 0.00 0.61 0.00 0.00 0.00 173.10 174.82 1orm n GLY 8 N 4.44 -0.31 3.84 0.20 0.00 -1.25 -0.92 105.19 111.18 1orm n GLY 8 Ca -0.22 0.72 -0.22 0.00 0.00 0.00 0.00 46.02 46.31 1orm n GLY 8 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1orm s TYR 9 N 0.00 3.01 0.11 1.61 5.04 -1.26 -2.11 117.35 123.74 1orm s TYR 9 Ca 0.00 -0.20 0.09 0.00 -2.44 0.00 0.00 57.07 54.52 1orm s TYR 9 Cb 0.00 -1.59 -0.04 0.00 0.35 0.00 0.00 41.96 40.68 1orm s TYR 9 CO 0.00 0.36 -0.20 0.00 -1.34 0.00 0.00 175.55 174.37 1orm s ALA 10 N -2.22 2.61 -0.49 3.97 0.00 -1.26 -3.90 121.76 120.48 1orm s ALA 10 Ca 0.37 -1.35 0.07 0.00 0.00 0.00 0.00 51.96 51.05 1orm s ALA 10 Cb -0.07 -0.61 0.19 0.00 0.00 0.00 0.00 23.12 22.63 1orm s ALA 10 CO 0.26 0.58 0.69 -1.14 0.00 0.00 0.00 175.76 176.14 1orm s GLN 11 N -2.03 1.01 0.21 0.00 0.74 -1.26 -4.66 119.66 113.67 1orm s GLN 11 Ca 0.17 -0.91 -0.21 0.00 0.05 0.00 0.00 55.36 54.46 1orm s GLN 11 Cb -0.10 -0.07 0.07 0.00 1.10 0.00 0.00 33.01 34.01 1orm s GLN 11 CO 0.09 -1.30 1.01 0.43 -0.55 0.00 0.00 175.29 174.97 1orm n SER 12 N 3.31 -1.80 -4.72 6.67 7.64 -1.26 -4.71 113.62 118.74 1orm n SER 12 Ca 0.17 -1.99 -0.29 0.00 1.01 0.00 0.00 58.87 57.77 1orm n SER 12 Cb 0.56 2.94 -0.08 0.00 -1.01 0.00 0.00 64.21 66.62 1orm n SER 12 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1orm s ASP 13 N -3.40 4.15 -0.01 6.43 -4.77 -1.26 -4.33 116.67 113.48 1orm s ASP 13 Ca 0.22 -1.40 -0.02 0.00 -3.30 0.00 0.00 52.55 48.05 1orm s ASP 13 Cb -0.03 -0.01 -0.00 0.00 -1.09 0.00 0.00 42.92 41.79 1orm s ASP 13 CO 0.06 -0.68 0.05 0.00 0.70 0.00 0.00 175.17 175.31 1orm s ALA 14 N -2.75 -0.12 0.00 2.11 0.00 -1.25 -1.88 121.76 117.86 1orm s ALA 14 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1orm s ALA 14 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.16 1orm s ALA 14 CO 0.14 -0.09 0.00 0.94 0.00 0.00 0.00 175.76 176.75 1orm n GLN 15 N 2.44 0.00 0.10 0.00 7.27 -1.13 -3.77 117.38 122.29 1orm n GLN 15 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.90 1orm n GLN 15 Cb 0.58 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.23 1orm n GLN 15 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1orm n GLY 16 N 0.00 -1.81 0.00 1.69 0.00 -1.26 -4.77 105.19 99.04 1orm n GLY 16 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1orm n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1orm n GLN 17 N -2.84 0.00 0.00 1.61 6.02 -1.25 -4.97 117.38 115.95 1orm n GLN 17 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1orm n GLN 17 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1orm n GLN 17 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 1orm n MET 18 N 0.00 0.00 -3.59 -1.09 1.56 -1.26 -5.10 117.12 107.64 1orm n MET 18 Ca 0.00 0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.32 1orm n MET 18 Cb 0.00 -0.83 -0.06 0.00 2.15 0.00 0.00 33.22 34.48 1orm n MET 18 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 1orm s ASN 19 N -4.31 -0.43 0.10 6.12 0.01 -1.26 -5.06 114.94 110.10 1orm s ASN 19 Ca 0.00 0.60 -0.30 0.00 -0.71 0.00 0.00 52.86 52.45 1orm s ASN 19 Cb 0.00 0.52 -0.06 0.00 0.41 0.00 0.00 41.25 42.12 1orm s ASN 19 CO 0.00 -0.32 1.03 -1.59 -1.51 0.00 0.00 177.10 174.72 1orm s LYS 20 N -0.71 4.61 0.47 -0.60 -2.85 -1.26 -4.80 119.74 114.60 1orm s LYS 20 Ca -0.01 1.56 -0.03 0.00 -1.00 0.00 0.00 55.97 56.49 1orm s LYS 20 Cb -0.02 -3.36 -0.02 0.00 -2.06 0.00 0.00 37.83 32.37 1orm s LYS 20 CO 0.00 0.06 0.73 0.00 0.10 0.00 0.00 175.35 176.25 1orm s MET 21 N 0.26 3.27 -0.05 1.78 0.23 -1.26 -4.64 119.30 118.88 1orm s MET 21 Ca 0.50 -0.13 -0.00 0.00 -1.03 0.00 0.00 55.69 55.03 1orm s MET 21 Cb -0.25 -2.46 0.03 0.00 -1.53 0.00 0.00 34.83 30.62 1orm s MET 21 CO 0.31 -0.26 -0.00 0.20 -2.03 0.00 0.00 175.02 173.23 1orm s GLY 22 N -4.16 0.39 0.11 3.16 0.00 -1.26 -4.83 107.32 100.72 1orm s GLY 22 Ca 0.48 -0.01 0.10 0.00 0.00 0.00 0.00 44.72 45.29 1orm s GLY 22 CO 0.41 0.88 -0.26 -0.32 0.00 0.00 0.00 173.10 173.81 1orm s GLY 23 N 1.54 1.52 -0.04 0.20 0.00 -1.26 -4.40 107.32 104.86 1orm s GLY 23 Ca -0.02 -1.41 -0.02 0.00 0.00 0.00 0.00 44.72 43.27 1orm s GLY 23 CO -0.03 -1.37 0.07 -0.12 0.00 0.00 0.00 173.10 171.65 1orm s PHE 24 N -1.01 0.01 0.07 1.90 5.36 -1.26 -4.13 117.98 118.93 1orm s PHE 24 Ca 0.13 0.30 -0.28 0.00 -0.96 0.00 0.00 56.93 56.12 1orm s PHE 24 Cb -0.10 -0.41 -0.05 0.00 -0.34 0.00 0.00 43.02 42.12 1orm s PHE 24 CO 0.05 -0.19 0.89 1.21 -1.46 0.00 0.00 175.22 175.72 1orm s ASN 25 N 2.03 7.37 -0.43 6.13 3.84 -0.90 -4.76 114.94 128.22 1orm s ASN 25 Ca 0.03 1.64 0.05 0.00 0.21 0.00 0.00 52.86 54.79 1orm s ASN 25 Cb -0.12 -2.54 0.31 0.00 -0.55 0.00 0.00 41.25 38.34 1orm s ASN 25 CO -0.03 -0.06 1.14 -0.11 -2.79 0.00 0.00 177.10 175.24 1orm n LEU 26 N 2.93 -2.19 -4.24 3.21 7.94 -1.26 -4.20 117.00 119.19 1orm n LEU 26 Ca 0.01 -3.20 -0.15 0.00 -1.11 0.00 0.00 56.01 51.55 1orm n LEU 26 Cb 0.50 0.91 -0.09 0.00 0.53 0.00 0.00 43.42 45.27 1orm n LEU 26 CO 0.50 1.95 -0.19 -0.54 -1.11 0.00 0.00 177.39 178.00 1orm s LYS 27 N 0.30 1.42 0.32 1.96 -0.14 -1.25 -4.96 119.74 117.39 1orm s LYS 27 Ca 0.24 -1.79 -0.12 0.00 -1.36 0.00 0.00 55.97 52.94 1orm s LYS 27 Cb 0.28 0.24 0.02 0.00 -1.68 0.00 0.00 37.83 36.69 1orm s LYS 27 CO -0.11 -0.48 0.61 1.52 -0.76 0.00 0.00 175.35 176.13 1orm s TYR 28 N -3.86 0.41 -0.04 3.18 -0.85 -1.26 -3.72 117.35 111.20 1orm s TYR 28 Ca 0.39 -0.85 0.01 0.00 -0.52 0.00 0.00 57.07 56.10 1orm s TYR 28 Cb 0.05 0.39 0.02 0.00 0.38 0.00 0.00 41.96 42.80 1orm s TYR 28 CO 0.18 -1.25 -0.03 0.50 -1.52 0.00 0.00 175.55 173.42 1orm s ARG 29 N -3.19 0.72 -0.13 -3.49 3.00 -1.26 -2.61 118.95 111.98 1orm s ARG 29 Ca 0.21 -0.06 0.02 0.00 -1.00 0.00 0.00 55.73 54.90 1orm s ARG 29 Cb -0.03 -0.79 0.01 0.00 0.00 0.00 0.00 34.95 34.15 1orm s ARG 29 CO 0.13 -0.11 -0.20 -0.47 0.00 0.00 0.00 175.30 174.65 1orm s TYR 30 N 1.02 2.48 -0.53 5.12 6.14 -1.26 -4.36 117.35 125.95 1orm s TYR 30 Ca -0.10 -1.25 0.04 0.00 0.64 0.00 0.00 57.07 56.40 1orm s TYR 30 Cb -0.14 -1.71 0.14 0.00 0.42 0.00 0.00 41.96 40.67 1orm s TYR 30 CO -0.01 -0.59 0.30 -2.00 0.64 0.00 0.00 175.55 173.89 1orm s GLU 31 N 0.92 1.86 -0.30 4.97 -6.30 -1.26 -4.69 118.70 113.90 1orm s GLU 31 Ca -0.06 -2.59 -0.14 0.00 -2.50 0.00 0.00 54.97 49.68 1orm s GLU 31 Cb -0.15 -3.04 0.18 0.00 0.00 0.00 0.00 34.13 31.12 1orm s GLU 31 CO -0.03 -1.16 1.13 -2.00 0.02 0.00 0.00 175.26 173.22 1orm s GLU 32 N -0.33 0.07 0.00 4.30 -6.30 -1.26 -2.14 118.70 113.03 1orm s GLU 32 Ca 0.19 0.07 0.00 0.00 -2.50 0.00 0.00 54.97 52.73 1orm s GLU 32 Cb -0.21 0.03 0.00 0.00 0.00 0.00 0.00 34.13 33.95 1orm s GLU 32 CO -0.03 -0.13 0.00 -3.47 0.02 0.00 0.00 175.26 171.65 1orm n ASP 33 N 5.05 0.00 0.00 -1.70 2.03 -1.26 -4.82 116.55 115.85 1orm n ASP 33 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.41 1orm n ASP 33 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 1orm n ASP 33 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1orm n ASN 34 N 0.00 0.00 -3.96 1.67 2.85 -1.26 -5.15 115.26 109.41 1orm n ASN 34 Ca 0.00 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.32 1orm n ASN 34 Cb 0.00 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 40.88 1orm n ASN 34 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1orm s SER 35 N 0.00 0.54 0.30 1.20 0.15 -1.26 -5.03 113.70 109.60 1orm s SER 35 Ca 0.00 -0.15 0.15 0.00 0.70 0.00 0.00 55.95 56.65 1orm s SER 35 Cb 0.00 -0.04 0.36 0.00 -1.71 0.00 0.00 66.02 64.63 1orm s SER 35 CO 0.00 0.01 1.59 1.55 1.20 0.00 0.00 173.24 177.59 1orm h PRO 36 N 5.81 0.00 -5.03 5.44 0.13 -2.00 -3.44 132.00 132.91 1orm h PRO 36 Ca -0.28 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.28 1orm h PRO 36 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 1orm h PRO 36 CO 0.49 0.54 -0.50 -0.48 -0.23 0.00 0.00 178.00 177.81 1orm s LEU 37 N -6.99 1.99 0.53 1.56 0.05 -1.26 -5.00 118.68 109.56 1orm s LEU 37 Ca 0.01 -1.71 0.05 0.00 0.05 0.00 0.00 54.13 52.53 1orm s LEU 37 Cb 0.10 -0.08 0.05 0.00 -2.05 0.00 0.00 46.19 44.21 1orm s LEU 37 CO 0.73 -0.96 0.74 -0.83 -0.55 0.00 0.00 176.35 175.48 1orm s GLY 38 N -3.62 1.84 -0.30 -3.48 0.00 -1.26 -4.92 107.32 95.58 1orm s GLY 38 Ca 0.23 -1.65 0.19 0.00 0.00 0.00 0.00 44.72 43.49 1orm s GLY 38 CO 0.15 -1.33 1.10 3.33 0.00 0.00 0.00 173.10 176.34 1orm n VAL 39 N -2.22 0.97 -3.63 1.40 0.24 -1.26 -3.56 118.33 110.25 1orm n VAL 39 Ca 0.10 -2.72 -0.04 0.00 -2.04 0.00 0.00 64.34 59.64 1orm n VAL 39 Cb 0.60 1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 33.92 1orm n VAL 39 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 1orm s ILE 40 N -2.94 0.00 0.00 1.34 2.07 -1.26 -4.55 121.20 115.86 1orm s ILE 40 Ca 0.25 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.49 1orm s ILE 40 Cb 0.39 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.98 1orm s ILE 40 CO -0.02 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.62 1orm n GLY 41 N 0.78 0.30 3.11 1.50 0.00 -1.07 -4.16 105.19 105.63 1orm n GLY 41 Ca -0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 46.02 45.68 1orm n GLY 41 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1orm s SER 42 N 0.00 -1.06 0.11 1.61 0.15 -1.26 -4.90 113.70 108.35 1orm s SER 42 Ca 0.00 -0.52 -0.23 0.00 0.70 0.00 0.00 55.95 55.89 1orm s SER 42 Cb 0.00 1.74 -0.07 0.00 -1.71 0.00 0.00 66.02 65.98 1orm s SER 42 CO 0.00 -0.24 0.71 0.72 1.20 0.00 0.00 173.24 175.63 1orm s PHE 43 N 2.19 3.84 -0.44 3.44 -0.12 -1.26 -4.54 117.98 121.09 1orm s PHE 43 Ca 0.14 1.48 0.06 0.00 -0.05 0.00 0.00 56.93 58.56 1orm s PHE 43 Cb -0.08 -2.69 0.22 0.00 -0.63 0.00 0.00 43.02 39.84 1orm s PHE 43 CO -0.15 0.48 0.60 2.41 -0.05 0.00 0.00 175.22 178.51 1orm n THR 44 N 1.91 -0.55 -3.77 -4.49 -1.04 -1.26 -5.01 114.28 100.07 1orm n THR 44 Ca -0.06 -2.81 -0.28 0.00 -2.04 0.00 0.00 64.05 58.86 1orm n THR 44 Cb 0.50 -0.60 -0.11 0.00 -1.82 0.00 0.00 70.33 68.29 1orm n THR 44 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1orm n TYR 45 N 2.04 2.73 -3.66 -1.42 4.02 -1.26 -4.35 117.16 115.25 1orm n TYR 45 Ca 0.20 -4.16 -0.10 0.00 -0.01 0.00 0.00 57.90 53.82 1orm n TYR 45 Cb 0.55 -0.50 -0.05 0.00 -0.02 0.00 0.00 39.34 39.31 1orm n TYR 45 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1orm s THR 46 N -1.40 0.07 0.00 -0.72 -1.32 -1.26 -4.32 115.64 106.70 1orm s THR 46 Ca 0.28 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 60.11 1orm s THR 46 Cb -0.01 -1.21 0.00 0.00 -1.51 0.00 0.00 72.50 69.77 1orm s THR 46 CO -0.16 -0.34 0.00 -0.62 -2.21 0.00 0.00 174.62 171.30 1orm n GLU 47 N -0.22 0.00 -1.58 7.08 -0.58 -1.26 -4.49 120.64 119.59 1orm n GLU 47 Ca -0.16 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.13 1orm n GLU 47 Cb 0.64 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.49 1orm n GLU 47 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1orm n LYS 48 N -0.73 1.31 -0.69 3.49 5.02 -1.26 -4.60 118.16 120.70 1orm n LYS 48 Ca 0.00 0.46 0.09 0.00 -2.02 0.00 0.00 58.31 56.84 1orm n LYS 48 Cb 0.00 -1.84 -0.02 0.00 -0.02 0.00 0.00 35.03 33.15 1orm n LYS 48 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1orm n SER 49 N 1.34 -6.40 0.00 4.39 3.41 -1.26 -4.61 113.62 110.49 1orm n SER 49 Ca 0.10 0.74 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 1orm n SER 49 Cb 0.31 -2.08 0.00 0.00 -0.26 0.00 0.00 64.21 62.19 1orm n SER 49 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1orm n ARG 50 N -2.86 0.00 0.00 4.33 0.63 -1.26 -4.88 116.66 112.62 1orm n ARG 50 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1orm n ARG 50 Cb 0.31 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.22 1orm n ARG 50 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1orm n THR 51 N 0.00 0.00 -2.00 5.15 -1.04 -1.26 -3.04 114.28 112.10 1orm n THR 51 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1orm n THR 51 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1orm n THR 51 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1orm n ALA 52 N -0.55 0.00 0.00 2.41 0.00 -1.26 -4.80 120.51 116.31 1orm n ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1orm n ALA 52 Cb 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1orm n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1orm n SER 53 N 1.97 0.00 -0.04 0.00 2.88 -1.26 -4.97 113.62 112.20 1orm n SER 53 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1orm n SER 53 Cb 0.50 0.37 -0.04 0.00 -0.75 0.00 0.00 64.21 64.28 1orm n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1orm n SER 54 N -2.25 3.43 -2.64 -3.46 2.88 -1.26 -5.04 113.62 105.27 1orm n SER 54 Ca 0.00 -0.03 -0.14 0.00 -1.33 0.00 0.00 58.87 57.38 1orm n SER 54 Cb 0.00 0.14 0.06 0.00 -0.75 0.00 0.00 64.21 63.66 1orm n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1orm n GLY 55 N 2.96 -0.09 0.00 0.46 0.00 -1.26 -4.96 105.19 102.30 1orm n GLY 55 Ca -0.13 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1orm n GLY 55 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1orm n ASP 56 N -2.08 0.00 0.00 1.61 8.00 -1.26 -5.03 116.55 117.79 1orm n ASP 56 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1orm n ASP 56 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 1orm n ASP 56 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1orm n TYR 57 N 2.36 0.00 -4.20 1.24 4.19 -1.26 -4.49 117.16 115.00 1orm n TYR 57 Ca 0.00 0.00 -0.12 0.00 3.31 0.00 0.00 57.90 61.09 1orm n TYR 57 Cb 0.00 0.00 -0.10 0.00 0.49 0.00 0.00 39.34 39.73 1orm n TYR 57 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1orm s ASN 58 N 0.00 1.22 0.00 2.98 2.47 -1.26 -4.14 114.94 116.21 1orm s ASN 58 Ca 0.00 -1.06 0.00 0.00 0.42 0.00 0.00 52.86 52.22 1orm s ASN 58 Cb 0.00 0.09 0.00 0.00 -1.45 0.00 0.00 41.25 39.89 1orm s ASN 58 CO 0.00 -0.48 0.00 0.29 -3.72 0.00 0.00 177.10 173.19 1orm n LYS 59 N -0.12 0.00 -1.88 0.43 4.01 -1.17 -4.02 118.16 115.41 1orm n LYS 59 Ca -0.10 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.40 1orm n LYS 59 Cb 0.61 0.00 0.16 0.00 -0.51 0.00 0.00 35.03 35.30 1orm n LYS 59 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1orm s ASN 60 N 0.87 3.38 0.88 4.39 2.47 -1.26 -4.51 114.94 121.16 1orm s ASN 60 Ca 0.00 0.43 -0.09 0.00 0.42 0.00 0.00 52.86 53.62 1orm s ASN 60 Cb 0.00 -0.60 0.18 0.00 -1.45 0.00 0.00 41.25 39.37 1orm s ASN 60 CO 0.00 -2.58 1.10 0.00 -3.72 0.00 0.00 177.10 171.90 1orm n GLN 61 N -3.70 -0.71 -3.56 0.43 3.00 -1.26 -4.97 117.38 106.61 1orm n GLN 61 Ca 0.13 -2.16 -0.29 0.00 -0.01 0.00 0.00 57.00 54.67 1orm n GLN 61 Cb 0.60 -0.99 -0.04 0.00 0.00 0.00 0.00 30.24 29.82 1orm n GLN 61 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.06 176.59 1orm s TYR 62 N -3.32 3.47 -0.21 1.08 5.04 -1.26 -5.02 117.35 117.12 1orm s TYR 62 Ca 0.66 0.53 -0.04 0.00 -2.44 0.00 0.00 57.07 55.78 1orm s TYR 62 Cb -0.03 -2.00 -0.01 0.00 0.35 0.00 0.00 41.96 40.27 1orm s TYR 62 CO 0.45 0.32 -0.03 -0.47 -1.34 0.00 0.00 175.55 174.48 1orm s TYR 63 N -1.88 2.97 -0.35 4.97 6.14 -1.26 -4.49 117.35 123.46 1orm s TYR 63 Ca 0.41 -0.79 0.04 0.00 0.64 0.00 0.00 57.07 57.38 1orm s TYR 63 Cb -0.11 -2.10 0.19 0.00 0.42 0.00 0.00 41.96 40.36 1orm s TYR 63 CO 0.28 -0.45 0.70 0.20 0.64 0.00 0.00 175.55 176.91 1orm s GLY 64 N 1.34 -1.27 -0.08 8.97 0.00 -1.26 -3.60 107.32 111.42 1orm s GLY 64 Ca 0.04 0.78 0.01 0.00 0.00 0.00 0.00 44.72 45.56 1orm s GLY 64 CO -0.01 3.78 -0.11 -0.26 0.00 0.00 0.00 173.10 176.50 1orm s ILE 65 N 2.29 3.33 0.00 0.90 -4.36 -1.26 -4.30 121.20 117.79 1orm s ILE 65 Ca 0.15 -0.60 0.00 0.00 -0.26 0.00 0.00 60.65 59.93 1orm s ILE 65 Cb -0.05 -2.36 0.00 0.00 1.25 0.00 0.00 42.46 41.30 1orm s ILE 65 CO -0.16 0.57 0.00 1.07 0.24 0.00 0.00 174.94 176.66 1orm n THR 66 N 2.66 0.00 -2.75 8.37 5.66 -1.26 -4.63 114.28 122.33 1orm n THR 66 Ca -0.18 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.80 1orm n THR 66 Cb 0.53 -1.60 0.02 0.00 -1.55 0.00 0.00 70.33 67.73 1orm n THR 66 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1orm s ALA 67 N -3.19 -3.88 0.00 1.79 0.00 -1.26 -4.80 121.76 110.42 1orm s ALA 67 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1orm s ALA 67 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1orm s ALA 67 CO 0.00 -2.45 0.00 0.41 0.00 0.00 0.00 175.76 173.72 1orm n GLY 68 N 3.03 0.71 0.12 0.00 0.00 -1.23 -4.94 105.19 102.87 1orm n GLY 68 Ca 0.11 -0.64 -0.03 0.00 0.00 0.00 0.00 46.02 45.47 1orm n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1orm h PRO 69 N 0.00 0.00 -5.31 1.61 0.13 -1.90 -3.44 132.00 123.08 1orm h PRO 69 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 1orm h PRO 69 Cb 0.00 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 30.82 1orm h PRO 69 CO 0.00 0.72 -0.83 0.00 -0.23 0.00 0.00 178.00 177.66 1orm s ALA 70 N -3.30 1.49 0.94 -0.56 0.00 -1.26 -4.63 121.76 114.44 1orm s ALA 70 Ca -0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.25 1orm s ALA 70 Cb 0.12 -0.48 0.04 0.00 0.00 0.00 0.00 23.12 22.79 1orm s ALA 70 CO 0.78 0.28 0.23 0.66 0.00 0.00 0.00 175.76 177.70 1orm n TYR 71 N 3.10 -3.92 -1.19 0.00 4.02 -1.26 -4.58 117.16 113.32 1orm n TYR 71 Ca -0.18 -0.22 0.05 0.00 -0.01 0.00 0.00 57.90 57.54 1orm n TYR 71 Cb 0.53 -0.17 0.21 0.00 -0.02 0.00 0.00 39.34 39.89 1orm n TYR 71 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1orm n ARG 72 N -1.47 2.18 -3.39 -0.72 1.85 -1.26 -4.78 116.66 109.07 1orm n ARG 72 Ca 0.03 -2.93 -0.27 0.00 -1.00 0.00 0.00 57.85 53.68 1orm n ARG 72 Cb 0.10 -1.76 -0.10 0.00 -1.05 0.00 0.00 32.46 29.65 1orm n ARG 72 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 1orm s ILE 73 N -3.00 0.26 -0.19 8.89 -4.36 -1.26 -5.09 121.20 116.45 1orm s ILE 73 Ca 0.41 -2.43 -0.09 0.00 -0.26 0.00 0.00 60.65 58.27 1orm s ILE 73 Cb 0.35 -1.19 0.07 0.00 1.25 0.00 0.00 42.46 42.94 1orm s ILE 73 CO 0.04 -1.16 0.44 0.54 0.24 0.00 0.00 174.94 175.04 1orm s ASN 74 N 0.26 -0.50 0.01 4.36 4.22 -1.26 -5.05 114.94 116.98 1orm s ASN 74 Ca 0.30 0.98 -0.25 0.00 -2.14 0.00 0.00 52.86 51.75 1orm s ASN 74 Cb -0.01 0.98 -0.18 0.00 1.28 0.00 0.00 41.25 43.32 1orm s ASN 74 CO -0.16 -0.21 1.35 0.44 -2.04 0.00 0.00 177.10 176.48 1orm h ASP 75 N 7.37 -0.09 0.00 3.54 5.19 -2.01 -3.43 116.42 127.00 1orm h ASP 75 Ca -0.31 -0.31 -0.12 0.00 -0.62 0.00 0.00 57.03 55.67 1orm h ASP 75 Cb 1.17 0.02 -0.11 0.00 0.18 0.00 0.00 39.33 40.59 1orm h ASP 75 CO 0.24 0.27 0.04 1.87 -3.12 0.00 0.00 179.24 178.55 1orm n TRP 76 N -4.97 -0.72 -3.55 4.55 -0.00 -1.26 -5.15 117.44 106.34 1orm n TRP 76 Ca -0.08 -0.91 -0.15 0.00 -0.00 0.00 0.00 57.50 56.35 1orm n TRP 76 Cb 0.21 1.24 -0.06 0.00 -0.00 0.00 0.00 31.31 32.70 1orm n TRP 76 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1orm s ALA 77 N 0.07 -1.82 0.72 5.87 0.00 -1.26 -5.17 121.76 120.16 1orm s ALA 77 Ca 0.17 1.47 -0.09 0.00 0.00 0.00 0.00 51.96 53.51 1orm s ALA 77 Cb 0.25 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 23.08 1orm s ALA 77 CO -0.14 -0.35 1.06 0.45 0.00 0.00 0.00 175.76 176.78 1orm s SER 78 N -1.00 4.88 0.00 0.00 0.15 -1.26 -4.80 113.70 111.68 1orm s SER 78 Ca -0.07 0.66 -0.06 0.00 0.70 0.00 0.00 55.95 57.18 1orm s SER 78 Cb -0.01 -1.32 -0.00 0.00 -1.71 0.00 0.00 66.02 62.98 1orm s SER 78 CO 0.06 -1.60 0.11 -0.51 1.20 0.00 0.00 173.24 172.50 1orm s ILE 79 N -3.33 0.08 0.17 6.45 1.10 -1.26 -4.97 121.20 119.44 1orm s ILE 79 Ca 0.60 -0.69 -0.06 0.00 -0.51 0.00 0.00 60.65 59.99 1orm s ILE 79 Cb -0.11 -0.39 -0.06 0.00 0.15 0.00 0.00 42.46 42.05 1orm s ILE 79 CO 0.47 -0.38 0.43 -0.72 -2.11 0.00 0.00 174.94 172.63 1orm s TYR 80 N -1.31 3.46 0.00 3.50 -0.85 -1.26 -4.57 117.35 116.32 1orm s TYR 80 Ca -0.14 0.63 0.00 0.00 -0.52 0.00 0.00 57.07 57.04 1orm s TYR 80 Cb -0.08 -2.07 0.00 0.00 0.38 0.00 0.00 41.96 40.20 1orm s TYR 80 CO 0.01 0.38 0.00 0.41 -1.52 0.00 0.00 175.55 174.83 1orm n GLY 81 N -0.04 -1.04 3.64 5.49 0.00 -1.26 -5.00 105.19 106.98 1orm n GLY 81 Ca -0.02 0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 1orm n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orm s VAL 82 N 0.00 5.03 -0.44 1.61 1.01 -1.26 -4.88 120.40 121.46 1orm s VAL 82 Ca 0.00 1.08 -0.13 0.00 0.00 0.00 0.00 61.98 62.93 1orm s VAL 82 Cb 0.00 -3.91 0.07 0.00 0.00 0.00 0.00 36.38 32.54 1orm s VAL 82 CO 0.00 0.08 0.33 0.68 0.00 0.00 0.00 175.10 176.20 1orm s VAL 83 N 2.17 4.87 0.01 2.92 -7.23 -1.26 -4.60 120.40 117.27 1orm s VAL 83 Ca 0.26 -1.13 -0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1orm s VAL 83 Cb -0.16 -3.90 -0.04 0.00 0.56 0.00 0.00 36.38 32.85 1orm s VAL 83 CO 0.09 -0.51 0.10 -0.83 -0.31 0.00 0.00 175.10 173.64 1orm s GLY 84 N 2.31 2.04 -0.48 2.32 0.00 -1.25 -4.17 107.32 108.09 1orm s GLY 84 Ca 0.04 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 43.91 1orm s GLY 84 CO 0.05 -0.77 0.33 0.14 0.00 0.00 0.00 173.10 172.85 1orm s VAL 85 N -1.24 1.19 -0.28 1.40 1.01 -1.26 -4.71 120.40 116.51 1orm s VAL 85 Ca 0.25 -2.86 -0.10 0.00 0.00 0.00 0.00 61.98 59.27 1orm s VAL 85 Cb -0.12 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1orm s VAL 85 CO 0.16 -1.05 0.16 -0.83 0.00 0.00 0.00 175.10 173.53 1orm s GLY 86 N -0.06 1.88 0.00 4.51 0.00 -1.24 -4.57 107.32 107.85 1orm s GLY 86 Ca 0.25 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.84 1orm s GLY 86 CO -0.11 0.63 0.00 2.98 0.00 0.00 0.00 173.10 176.60 1orm n TYR 87 N 5.02 0.00 -3.32 1.90 9.36 -1.26 -3.44 117.16 125.42 1orm n TYR 87 Ca -0.15 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.07 1orm n TYR 87 Cb 0.52 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.23 1orm n TYR 87 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1orm n GLY 88 N -0.18 -0.64 3.53 2.98 0.00 -1.26 -5.05 105.19 104.56 1orm n GLY 88 Ca 0.00 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 1orm n GLY 88 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1orm s LYS 89 N -0.64 3.35 0.05 1.61 -2.85 -1.26 -4.96 119.74 115.04 1orm s LYS 89 Ca 0.00 -0.26 -0.03 0.00 -1.00 0.00 0.00 55.97 54.68 1orm s LYS 89 Cb 0.00 -3.93 0.01 0.00 -2.06 0.00 0.00 37.83 31.85 1orm s LYS 89 CO 0.00 -1.01 0.16 1.19 0.10 0.00 0.00 175.35 175.80 1orm n PHE 90 N 6.35 -0.98 0.00 1.78 3.72 -1.26 -5.00 117.46 122.06 1orm n PHE 90 Ca -0.01 -0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 1orm n PHE 90 Cb 0.48 0.14 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 1orm n PHE 90 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1orm n GLN 91 N -0.11 0.00 0.00 -1.08 6.02 -1.26 -3.95 117.38 116.99 1orm n GLN 91 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1orm n GLN 91 Cb 0.11 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.37 1orm n GLN 91 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1orm n THR 92 N 0.00 0.00 0.00 5.09 -1.04 -1.26 -4.28 114.28 112.79 1orm n THR 92 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1orm n THR 92 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1orm n THR 92 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1orm n THR 93 N 0.00 0.00 0.00 12.58 -1.04 -1.26 -4.05 114.28 120.51 1orm n THR 93 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1orm n THR 93 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1orm n THR 93 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1orm n GLU 94 N 0.00 0.00 -3.60 -2.82 1.02 -1.26 -4.69 120.64 109.29 1orm n GLU 94 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1orm n GLU 94 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1orm n GLU 94 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1orm s TYR 95 N 0.00 -0.01 -1.11 -0.32 2.02 -1.26 -5.04 117.35 111.63 1orm s TYR 95 Ca 0.00 -0.02 -0.22 0.00 -0.37 0.00 0.00 57.07 56.46 1orm s TYR 95 Cb 0.00 0.52 -0.00 0.00 -0.40 0.00 0.00 41.96 42.07 1orm s TYR 95 CO 0.00 -0.09 1.76 -1.25 -1.57 0.00 0.00 175.55 174.40 1orm s PRO 96 N -2.13 3.17 -0.89 -1.71 0.04 -1.26 -4.16 135.00 128.06 1orm s PRO 96 Ca 0.16 -1.16 -0.06 0.00 0.04 0.00 0.00 61.00 59.97 1orm s PRO 96 Cb 0.07 -5.31 -0.01 0.00 0.04 0.00 0.00 34.50 29.29 1orm s PRO 96 CO -0.06 -2.94 0.72 0.25 0.04 0.00 0.00 177.00 175.01 1orm n THR 97 N 7.23 -7.22 -3.03 1.26 -2.24 -1.26 -4.95 114.28 104.07 1orm n THR 97 Ca 0.42 -0.47 -0.25 0.00 -2.27 0.00 0.00 64.05 61.47 1orm n THR 97 Cb 0.48 -5.20 -0.04 0.00 -2.10 0.00 0.00 70.33 63.46 1orm n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1orm n TYR 98 N -2.76 3.16 -1.30 4.78 9.36 -1.26 -5.04 117.16 124.11 1orm n TYR 98 Ca -0.11 -3.97 -0.41 0.00 3.32 0.00 0.00 57.90 56.73 1orm n TYR 98 Cb 0.58 -0.48 0.00 0.00 -0.63 0.00 0.00 39.34 38.82 1orm n TYR 98 CO 0.00 0.00 0.00 0.36 0.22 0.00 0.00 176.86 177.44 1orm n LYS 99 N -0.02 0.04 0.15 2.98 0.00 -1.25 -4.60 118.16 115.45 1orm n LYS 99 Ca 0.29 0.02 0.18 0.00 -0.00 0.00 0.00 58.31 58.80 1orm n LYS 99 Cb 0.45 -1.04 0.65 0.00 -0.00 0.00 0.00 35.03 35.09 1orm n LYS 99 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.40 176.43 1orm h ASN 100 N 0.24 0.00 -5.61 -5.58 -0.73 -1.84 -3.46 115.58 98.59 1orm h ASN 100 Ca -0.39 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 57.76 1orm h ASN 100 Cb 1.44 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.04 1orm h ASN 100 CO 0.46 0.00 -0.97 0.47 -0.37 0.00 0.00 177.43 177.02 1orm n ASP 101 N -3.26 -7.45 0.15 1.15 9.92 -1.26 -4.97 116.55 110.83 1orm n ASP 101 Ca 0.06 0.96 0.00 0.00 -0.53 0.00 0.00 54.79 55.27 1orm n ASP 101 Cb 0.71 -3.98 0.00 0.00 -0.64 0.00 0.00 41.12 37.21 1orm n ASP 101 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1orm n THR 102 N 0.76 0.00 0.00 -3.53 -1.04 -1.26 -5.00 114.28 104.21 1orm n THR 102 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1orm n THR 102 Cb 0.23 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.62 1orm n THR 102 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1orm n SER 103 N -3.18 0.00 0.00 8.00 7.64 -1.26 -4.69 113.62 120.14 1orm n SER 103 Ca 0.00 0.80 0.00 0.00 1.01 0.00 0.00 58.87 60.68 1orm n SER 103 Cb 0.00 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1orm n SER 103 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1orm n ASP 104 N -2.08 0.00 -3.32 6.43 2.03 -1.26 -4.23 116.55 114.12 1orm n ASP 104 Ca 0.00 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.06 1orm n ASP 104 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1orm n ASP 104 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1orm n TYR 105 N 0.00 0.63 -1.71 -0.67 4.01 -1.26 -4.81 117.16 113.36 1orm n TYR 105 Ca 0.00 -3.69 -0.43 0.00 -0.16 0.00 0.00 57.90 53.62 1orm n TYR 105 Cb 0.00 -0.30 -0.02 0.00 -0.31 0.00 0.00 39.34 38.71 1orm n TYR 105 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1orm n GLY 106 N 1.58 0.94 3.36 2.72 0.00 -1.22 -4.96 105.19 107.60 1orm n GLY 106 Ca 0.24 0.43 -0.39 0.00 0.00 0.00 0.00 46.02 46.30 1orm n GLY 106 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1orm s PHE 107 N -0.34 3.23 -0.27 1.61 0.40 -1.26 -4.45 117.98 116.89 1orm s PHE 107 Ca 0.63 -1.03 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 1orm s PHE 107 Cb -0.57 -2.38 0.08 0.00 0.51 0.00 0.00 43.02 40.65 1orm s PHE 107 CO 0.53 -0.64 -0.01 -1.54 0.70 0.00 0.00 175.22 174.26 1orm s SER 108 N 1.52 4.15 0.08 1.36 1.04 -1.26 -4.66 113.70 115.93 1orm s SER 108 Ca 0.01 -1.49 0.06 0.00 0.48 0.00 0.00 55.95 55.01 1orm s SER 108 Cb -0.19 -1.27 -0.03 0.00 0.10 0.00 0.00 66.02 64.63 1orm s SER 108 CO 0.05 -0.29 -0.16 -0.31 0.98 0.00 0.00 173.24 173.51 1orm s TYR 109 N 1.28 1.37 -0.02 5.02 2.02 -1.26 -3.96 117.35 121.81 1orm s TYR 109 Ca 0.00 -0.44 -0.04 0.00 -0.37 0.00 0.00 57.07 56.22 1orm s TYR 109 Cb -0.19 -0.77 0.00 0.00 -0.40 0.00 0.00 41.96 40.61 1orm s TYR 109 CO -0.09 0.09 0.09 0.20 -1.57 0.00 0.00 175.55 174.27 1orm s GLY 110 N -1.72 0.01 0.08 0.71 0.00 -1.26 -3.87 107.32 101.26 1orm s GLY 110 Ca 0.01 0.04 -0.17 0.00 0.00 0.00 0.00 44.72 44.60 1orm s GLY 110 CO 0.03 -0.03 0.53 0.00 0.00 0.00 0.00 173.10 173.62 1orm s ALA 111 N -0.57 3.61 -1.03 3.20 0.00 -1.26 -4.29 121.76 121.42 1orm s ALA 111 Ca -0.06 -0.08 -0.06 0.00 0.00 0.00 0.00 51.96 51.76 1orm s ALA 111 Cb -0.04 -2.54 0.26 0.00 0.00 0.00 0.00 23.12 20.79 1orm s ALA 111 CO 0.00 0.44 0.99 0.41 0.00 0.00 0.00 175.76 177.60 1orm n GLY 112 N 1.43 4.21 3.27 0.00 0.00 -1.26 -4.15 105.19 108.69 1orm n GLY 112 Ca -0.09 -2.60 -0.34 0.00 0.00 0.00 0.00 46.02 42.99 1orm n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1orm s LEU 113 N -1.38 2.70 -0.02 0.99 1.98 -1.26 -4.25 118.68 117.44 1orm s LEU 113 Ca 0.30 -0.45 0.06 0.00 -2.89 0.00 0.00 54.13 51.15 1orm s LEU 113 Cb -0.08 -1.67 -0.01 0.00 0.66 0.00 0.00 46.19 45.08 1orm s LEU 113 CO -0.09 -0.01 -0.21 0.00 -1.89 0.00 0.00 176.35 174.14 1orm s GLN 114 N 1.40 1.79 -0.37 1.98 -2.07 -1.26 -4.07 119.66 117.06 1orm s GLN 114 Ca 0.05 -0.76 0.07 0.00 -1.82 0.00 0.00 55.36 52.90 1orm s GLN 114 Cb -0.14 -1.70 0.18 0.00 -1.09 0.00 0.00 33.01 30.27 1orm s GLN 114 CO -0.05 0.44 0.60 0.12 -1.32 0.00 0.00 175.29 175.07 1orm s PHE 115 N -0.43 -1.69 -0.30 9.60 5.36 -1.26 -5.04 117.98 124.21 1orm s PHE 115 Ca 0.06 0.48 -0.18 0.00 -0.96 0.00 0.00 56.93 56.34 1orm s PHE 115 Cb -0.09 0.27 0.18 0.00 -0.34 0.00 0.00 43.02 43.05 1orm s PHE 115 CO -0.00 -1.14 1.18 1.21 -1.46 0.00 0.00 175.22 175.01 1orm s ASN 116 N 2.17 -0.26 -1.22 6.13 3.84 -1.26 -4.94 114.94 119.40 1orm s ASN 116 Ca 0.14 0.35 -0.20 0.00 0.21 0.00 0.00 52.86 53.36 1orm s ASN 116 Cb -0.07 1.29 -0.02 0.00 -0.55 0.00 0.00 41.25 41.91 1orm s ASN 116 CO -0.14 -0.05 1.88 -0.81 -2.79 0.00 0.00 177.10 175.19 1orm n PRO 117 N 4.71 2.37 -2.71 0.43 -0.04 -1.26 -4.54 135.00 133.95 1orm n PRO 117 Ca -0.07 -2.76 -0.05 0.00 -0.04 0.00 0.00 63.50 60.58 1orm n PRO 117 Cb 0.54 -3.52 0.04 0.00 -0.04 0.00 0.00 33.50 30.53 1orm n PRO 117 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1orm n MET 118 N 8.00 0.38 0.16 0.54 2.81 -1.26 -4.99 117.12 122.76 1orm n MET 118 Ca 0.48 -1.30 0.18 0.00 -1.81 0.00 0.00 57.70 55.25 1orm n MET 118 Cb 0.45 -0.74 0.79 0.00 -0.71 0.00 0.00 33.22 33.01 1orm n MET 118 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1orm h GLU 119 N 4.07 0.00 0.00 0.03 5.08 -2.02 0.63 114.58 122.37 1orm h GLU 119 Ca -0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1orm h GLU 119 Cb 1.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1orm h GLU 119 CO 0.01 0.00 -0.06 -0.97 -1.00 0.00 0.00 179.01 176.98 1orm h ASN 120 N 0.00 0.00 -0.85 1.42 -1.24 -1.96 -3.40 115.58 109.54 1orm h ASN 120 Ca 0.13 0.00 0.12 0.00 0.71 0.00 0.00 56.30 57.26 1orm h ASN 120 Cb 0.68 0.00 -0.21 0.00 0.73 0.00 0.00 38.32 39.52 1orm h ASN 120 CO -0.00 0.06 -0.18 0.54 -1.29 0.00 0.00 177.43 176.56 1orm s VAL 121 N -4.12 -0.85 0.18 2.57 0.11 0.22 -4.70 120.40 113.81 1orm s VAL 121 Ca -0.03 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 1orm s VAL 121 Cb 0.12 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 1orm s VAL 121 CO 0.53 0.00 0.36 0.00 -3.33 0.00 0.00 175.10 172.67 1orm s ALA 122 N 2.88 3.86 -0.31 1.54 0.00 -1.18 -4.55 121.76 124.00 1orm s ALA 122 Ca 0.16 -0.83 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 1orm s ALA 122 Cb -0.14 -1.97 0.10 0.00 0.00 0.00 0.00 23.12 21.11 1orm s ALA 122 CO -0.19 0.50 0.08 -0.51 0.00 0.00 0.00 175.76 175.64 1orm s LEU 123 N -3.19 2.54 0.46 0.00 1.02 -1.26 -4.32 118.68 113.93 1orm s LEU 123 Ca 0.38 -1.66 0.06 0.00 0.02 0.00 0.00 54.13 52.93 1orm s LEU 123 Cb -0.11 -0.96 -0.02 0.00 0.02 0.00 0.00 46.19 45.11 1orm s LEU 123 CO 0.28 -0.40 0.23 1.51 0.02 0.00 0.00 176.35 178.00 1orm s ASP 124 N 1.53 4.49 -0.11 2.29 -4.77 -1.22 -4.43 116.67 114.45 1orm s ASP 124 Ca 0.09 -1.18 -0.30 0.00 -3.30 0.00 0.00 52.55 47.86 1orm s ASP 124 Cb -0.17 -0.10 0.10 0.00 -1.09 0.00 0.00 42.92 41.65 1orm s ASP 124 CO -0.22 -0.75 0.83 0.72 0.70 0.00 0.00 175.17 176.45 1orm s PHE 125 N -2.68 -0.53 0.03 2.11 -0.12 -1.26 -2.64 117.98 112.90 1orm s PHE 125 Ca 0.35 0.93 0.01 0.00 -0.05 0.00 0.00 56.93 58.17 1orm s PHE 125 Cb 0.01 0.42 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 1orm s PHE 125 CO 0.20 -0.48 -0.05 -1.54 -0.05 0.00 0.00 175.22 173.30 1orm s SER 126 N -1.08 0.52 -0.21 1.98 1.04 -1.26 -4.37 113.70 110.32 1orm s SER 126 Ca -0.06 -0.53 -0.05 0.00 0.48 0.00 0.00 55.95 55.78 1orm s SER 126 Cb -0.00 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 1orm s SER 126 CO 0.06 -0.27 -0.01 -0.72 0.98 0.00 0.00 173.24 173.29 1orm s TYR 127 N -1.49 3.01 -0.21 5.02 1.13 -1.26 -4.66 117.35 118.90 1orm s TYR 127 Ca -0.13 -0.60 -0.04 0.00 -1.41 0.00 0.00 57.07 54.89 1orm s TYR 127 Cb -0.10 -2.11 -0.02 0.00 -1.10 0.00 0.00 41.96 38.64 1orm s TYR 127 CO -0.01 -0.35 -0.02 -2.00 -2.51 0.00 0.00 175.55 170.67 1orm s GLU 128 N 1.22 3.50 0.05 -3.49 2.12 -1.25 -4.38 118.70 116.47 1orm s GLU 128 Ca 0.03 -0.57 0.04 0.00 0.36 0.00 0.00 54.97 54.83 1orm s GLU 128 Cb -0.15 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 1orm s GLU 128 CO 0.01 -0.09 -0.03 1.14 -0.54 0.00 0.00 175.26 175.75 1orm s GLN 129 N 1.25 2.55 -0.08 4.30 -2.07 -1.26 -4.66 119.66 119.68 1orm s GLN 129 Ca 0.03 -0.78 0.03 0.00 -1.82 0.00 0.00 55.36 52.82 1orm s GLN 129 Cb -0.14 -2.53 -0.02 0.00 -1.09 0.00 0.00 33.01 29.23 1orm s GLN 129 CO 0.00 0.57 -0.17 0.45 -1.32 0.00 0.00 175.29 174.82 1orm s SER 130 N -1.90 3.71 -0.48 12.60 0.15 -1.26 -4.71 113.70 121.82 1orm s SER 130 Ca 0.22 -0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.55 1orm s SER 130 Cb -0.11 -1.16 0.60 0.00 -1.71 0.00 0.00 66.02 63.63 1orm s SER 130 CO 0.13 0.24 1.88 0.54 1.20 0.00 0.00 173.24 177.23 1orm n ARG 131 N 2.99 2.34 -2.26 5.44 1.74 -1.26 -2.25 116.66 123.40 1orm n ARG 131 Ca -0.18 -3.13 -0.38 0.00 -0.77 0.00 0.00 57.85 53.39 1orm n ARG 131 Cb 0.52 -2.17 0.03 0.00 -1.02 0.00 0.00 32.46 29.82 1orm n ARG 131 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1orm n ILE 132 N -1.08 4.23 -3.69 0.55 -5.35 -1.26 -4.80 119.36 107.95 1orm n ILE 132 Ca 0.57 -4.96 -0.22 0.00 -0.27 0.00 0.00 62.75 57.87 1orm n ILE 132 Cb 1.35 -1.35 0.04 0.00 -1.74 0.00 0.00 39.64 37.95 1orm n ILE 132 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1orm n ARG 133 N -0.37 -5.34 0.06 6.28 5.12 -1.26 -4.86 116.66 116.29 1orm n ARG 133 Ca 0.49 0.66 0.00 0.00 -1.93 0.00 0.00 57.85 57.07 1orm n ARG 133 Cb 0.29 -5.34 0.00 0.00 -1.16 0.00 0.00 32.46 26.25 1orm n ARG 133 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1orm n SER 134 N -3.04 0.11 -3.41 0.55 7.64 -1.26 -4.99 113.62 109.22 1orm n SER 134 Ca -0.24 0.21 -0.22 0.00 1.01 0.00 0.00 58.87 59.63 1orm n SER 134 Cb 0.65 0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.94 1orm n SER 134 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1orm n VAL 135 N -3.04 -0.60 -2.54 0.44 0.24 -0.95 -4.70 118.33 107.18 1orm n VAL 135 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1orm n VAL 135 Cb 0.00 -1.21 0.03 0.00 -1.47 0.00 0.00 33.84 31.19 1orm n VAL 135 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1orm n ASP 136 N -2.16 0.52 -4.42 -1.34 2.03 -1.26 -5.01 116.55 104.91 1orm n ASP 136 Ca 0.01 -2.03 -0.44 0.00 0.52 0.00 0.00 54.79 52.85 1orm n ASP 136 Cb 0.52 -0.13 -0.05 0.00 -0.72 0.00 0.00 41.12 40.74 1orm n ASP 136 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1orm s VAL 137 N -1.11 4.77 0.12 5.18 1.01 -1.26 -2.84 120.40 126.26 1orm s VAL 137 Ca 0.23 -0.65 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 1orm s VAL 137 Cb 0.31 -4.43 -0.07 0.00 0.00 0.00 0.00 36.38 32.19 1orm s VAL 137 CO -0.10 -1.02 0.67 -0.83 0.00 0.00 0.00 175.10 173.82 1orm s GLY 138 N 3.20 2.80 -0.28 4.51 0.00 -0.79 -4.61 107.32 112.15 1orm s GLY 138 Ca 0.15 0.20 0.01 0.00 0.00 0.00 0.00 44.72 45.08 1orm s GLY 138 CO 0.10 0.66 0.37 -1.59 0.00 0.00 0.00 173.10 172.64 1orm s THR 139 N -1.13 -0.55 -0.49 0.90 2.01 -1.26 -4.49 115.64 110.62 1orm s THR 139 Ca 0.32 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 62.04 1orm s THR 139 Cb -0.21 -0.97 0.39 0.00 0.01 0.00 0.00 72.50 71.72 1orm s THR 139 CO 0.23 -0.33 1.06 0.79 -0.69 0.00 0.00 174.62 175.68 1orm n TRP 140 N 5.34 3.64 -0.58 4.92 8.01 -1.26 -4.47 117.44 133.05 1orm n TRP 140 Ca -0.01 -3.42 -0.22 0.00 -1.31 0.00 0.00 57.50 52.54 1orm n TRP 140 Cb 0.48 -0.23 0.20 0.00 -2.01 0.00 0.00 31.31 29.75 1orm n TRP 140 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.69 177.12 1orm n ILE 141 N -0.40 0.00 -3.30 -0.99 -5.35 -1.26 -4.80 119.36 103.27 1orm n ILE 141 Ca 0.36 -0.20 -0.10 0.00 -0.27 0.00 0.00 62.75 62.54 1orm n ILE 141 Cb 0.56 -0.97 -0.05 0.00 -1.74 0.00 0.00 39.64 37.44 1orm n ILE 141 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1orm s ALA 142 N -2.61 -1.18 0.09 -1.28 0.00 -1.25 -4.69 121.76 110.84 1orm s ALA 142 Ca 0.50 -0.54 -0.31 0.00 0.00 0.00 0.00 51.96 51.62 1orm s ALA 142 Cb -0.07 -2.33 -0.08 0.00 0.00 0.00 0.00 23.12 20.65 1orm s ALA 142 CO 0.40 -2.18 1.52 0.20 0.00 0.00 0.00 175.76 175.71 1orm s GLY 143 N 1.56 1.71 -0.10 0.00 0.00 -1.08 -3.84 107.32 105.57 1orm s GLY 143 Ca 0.17 1.16 -0.04 0.00 0.00 0.00 0.00 44.72 46.00 1orm s GLY 143 CO -0.04 2.64 0.22 -1.34 0.00 0.00 0.00 173.10 174.57 1orm s VAL 144 N 1.92 -0.25 0.00 1.40 -7.23 -0.10 -3.39 120.40 112.75 1orm s VAL 144 Ca 0.69 0.27 0.00 0.00 -1.81 0.00 0.00 61.98 61.12 1orm s VAL 144 Cb -0.38 -0.36 0.00 0.00 0.56 0.00 0.00 36.38 36.19 1orm s VAL 144 CO 0.30 0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.81 1orm n GLY 145 N 4.99 6.30 3.00 2.32 0.00 -1.26 -1.50 105.19 119.03 1orm n GLY 145 Ca -0.12 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1orm n GLY 145 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1orm s TYR 146 N -0.12 0.06 -0.40 1.61 1.51 -0.86 -4.73 117.35 114.42 1orm s TYR 146 Ca 0.00 -0.12 -0.05 0.00 -1.01 0.00 0.00 57.07 55.89 1orm s TYR 146 Cb 0.00 -0.06 0.09 0.00 -0.11 0.00 0.00 41.96 41.88 1orm s TYR 146 CO 0.00 -0.15 0.20 0.50 -1.11 0.00 0.00 175.55 174.99 1orm s ARG 147 N -0.79 2.30 0.00 -0.62 3.52 -1.26 -0.46 118.95 121.63 1orm s ARG 147 Ca -0.09 -1.61 0.00 0.00 -0.13 0.00 0.00 55.73 53.90 1orm s ARG 147 Cb -0.05 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.73 1orm s ARG 147 CO 0.00 -0.97 0.00 0.34 -0.81 0.00 0.00 175.30 173.86